4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-4-oxidanylidene-butanamide

Systemtic Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-yl-ethyl]-4-oxidanylidene-butanamide Openeye Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]-4-oxo-butanamide CAS Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2S)-2-(4-morpholinyl)-2-thiophen-2-ylethyl]-4-oxobutanamide IUPAC Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-4-oxobutanamide Traditional Name: 4-(2,3-dihydro-1,4-benzodioxin-6-yl)-4-keto-N-[(2S)-2-morpholino-2-(2-thienyl)ethyl]butyramide Formula: C22H26N2O5S MolecularWeight: 430.51724

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Descriptors Computed from Structure

Canonical SMILES:

C1COCCN1C(CNC(=O)CCC(=O)C2=CC3=C(C=C2)OCCO3)C4=CC=CS4

Isomeric SMILES

C1COCCN1[C@@H](CNC(=O)CCC(=O)C2=CC3=C(C=C2)OCCO3)C4=CC=CS4

InChI

InChI=1S/C22H26N2O5S/c25-18(16-3-5-19-20(14-16)29-12-11-28-19)4-6-22(26)23-15-17(21-2-1-13-30-21)24-7-9-27-10-8-24/h1-3,5,13-14,17H,4,6-12,15H2,(H,23,26)/t17-/m0/s1